이름: 2-(4-iodophenoxy)-4,6-dimethoxypyrimidine
SMILES:
COc1cc(OC)nc(Oc2ccc(I)cc2)n1Molecular Processing
Molecular formula
C12H11IN2O3
Molecular weight
358.14
Exact mass
357.9814
XLogP
2.89
TPSA
53.47
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
74.37
Supplementary Information
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